2-[3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-2,4-bis(oxidanylidene)-4a,5,6,7,8,8a-hexahydroquinazolin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-2,4-bis(oxidanylidene)-4a,5,6,7,8,8a-hexahydroquinazolin-1-yl]ethanoic acid Openeye Name: 2-[3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-2,4-dioxo-4a,5,6,7,8,8a-hexahydroquinazolin-1-yl]acetic acid CAS Name: 2-[3-[2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]ethyl]-2,4-dioxo-4a,5,6,7,8,8a-hexahydroquinazolin-1-yl]acetic acid IUPAC Name: 2-[3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-2,4-dioxo-4a,5,6,7,8,8a-hexahydroquinazolin-1-yl]acetic acid Traditional Name: 2-[3-[2-(9H-fluoren-9-ylmethoxycarbonylamino)ethyl]-2,4-diketo-4a,5,6,7,8,8a-hexahydroquinazolin-1-yl]acetic acid Formula: C27H29N3O6 MolecularWeight: 491.53566

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)C(=O)N(C(=O)N2CC(=O)O)CCNC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

Isomeric SMILES

C1CCC2C(C1)C(=O)N(C(=O)N2CC(=O)O)CCNC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35

InChI

InChI=1S/C27H29N3O6/c31-24(32)15-30-23-12-6-5-11-21(23)25(33)29(27(30)35)14-13-28-26(34)36-16-22-19-9-3-1-7-17(19)18-8-2-4-10-20(18)22/h1-4,7-10,21-23H,5-6,11-16H2,(H,28,34)(H,31,32)